Geometry & MOs

Info

ID:	51408
PubChem CID:	12014069
Reduced:	FO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	266.131823
ΔH_f, kcal/mol:	-152.14
Dipole, Da:	3.14
IP(EA), eV:	-9.58(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2S)-2-fluoro-2-[(R)-hydroxy-(4-methylphenyl)methyl]pent-4-enoate

Drug info:

PubChemData

Smile

CCOC(=O)[C@](CC=C)([C@@H](C1=CC=CC=C1)O)F

DOS

IR

Vibrations